Geometry & MOs

Info

ID:	88878
PubChem CID:	49957373
Reduced:	ClSO3N4C19H19 (1)
Stoich.:	ABC3D4E19F19 (1)
Weight, g/mol:	350.049191
ΔH_f, kcal/mol:	-17.23
Dipole, Da:	7.4
IP(EA), eV:	-9.02(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-chlorophenoxy)ethylsulfonyl]-1-methylbenzimidazole

Drug info:

PubChemData

Smile

CCCN1C2=CC=CC=C2N3C1=NN=C3S(=O)(=O)CCOC4=CC=C(C=C4)Cl

DOS

IR

Vibrations